(2-oxidanylidene-4-propyl-chromen-7-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C22H23NO6S MolecularWeight: 429.48612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H23NO6S/c1-3-4-16-13-22(25)29-20-14-17(7-10-19(16)20)28-21(24)11-12-23-30(26,27)18-8-5-15(2)6-9-18/h5-10,13-14,23H,3-4,11-12H2,1-2H3